| SpectraBase Spectrum ID |
G3wveEDMIJT |
| Name |
(5S,7ar)-5-Phenyl-1,5,7,7A-tetrahydro-[1,3]thiazolo[3,4-C][1,3]oxazol-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
221.051049770 u |
| Formula |
C11H11NO2S |
| InChI |
InChI=1S/C11H11NO2S/c13-11-12-9(6-14-11)7-15-10(12)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2/t9-,10+/m1/s1 |
| InChIKey |
OYRJOHTTZHMMQQ-ZJUUUORDSA-N |
| Molecular Weight |
221.274 g/mol |
| SMILES |
C1(OC[C@]2(N1[C@@](SC2)(C=1C=CC=CC1)[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888169 |
![(5S,7aR)-5-phenyl-1,5,7,7a-tetrahydro-[1,3]thiazolo[3,4-c][1,3]oxazol-3-one](/api/spectrum/G3wveEDMIJT/structure.png?h=300&w=458 "(5S,7aR)-5-phenyl-1,5,7,7a-tetrahydro-[1,3]thiazolo[3,4-c][1,3]oxazol-3-one")
